Basic information
- CAS
69408-26-0- Standard SMILES
NC(CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1- InChIKey
DHQUQYYPAWHGAR-UHFFFAOYSA-N- Molecular formula
- C19H21NO4
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 327.14705815
Names & identifiers
- Preferred name
- Dibenzyl 2-aminopentanedioate
- IUPAC
- dibenzyl 2-aminopentanedioate
- English name
- dibenzyl 2-aMinopentanedioate
- Molecular formula
- C19H21NO4
- Molecular weight
- 327.37
Names & synonyms
dibenzyl 2-aminopentanedioate69408-26-0DTXSID10276774RefChem:337273DTXCID00228005DL-Glutamic acid dibenzyl esterdibenzyl (2S)-2-azanylpentanedioateD-GlutaMic acid, 1,5-bis(phenylMethyl) esterMFCD00382428DL-Glutamic acid 1,5-bisbenzyl esterdibenzyl glutamateDibenzyl D-glutamate
Show more names
DIBENZYL DL-ASPARTATEDL-?Glutamic acid dibenzyl esterGlutamic acid, bis(phenylmethyl) esterGlutamic acid, 1,5-bis(phenylmethyl) ester
47376-46-5benzylglutamatedibenzyl2-aminopentanedioateDIBENZYL DL-GLUTAMATESCHEMBL124384CHEMBL3889580NSC163301AKOS004111029
Database identifiers
- CAS
69408-26-0- PubChem CID
- 199614
- DTXSID
DTXSID10276774- ChEMBL
CHEMBL3889580- Nikkaji
- J1.105.550H
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 387
Physicochemical properties
- Boiling point
- 453.5 · 453.5±40.0 °C(Predicted)
- Density
- 1.183 · 1.183±0.06 g/cm3(Predicted)
- pka
- 6.78 · 6.78±0.35(Predicted)
Chemistry & industry
Suppliers6 total
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
南京恰风和医药科技有限公司025-57018978 18251899859 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海特伯化学科技有限公司021-58170097 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
Related reactions
4 records
Compound notes
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